1-(5-methylsulfonylpyridin-2-yl)-5-(propan-2-ylamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(propan-2-ylamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-(isopropylamino)-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-(propan-2-ylamino)-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(propan-2-ylamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-(isopropylamino)-1-(5-mesyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C14H14F3N5O2S MolecularWeight: 373.35347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C#N

Isomeric SMILES

CC(C)NC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F)C#N

InChI

InChI=1S/C14H14F3N5O2S/c1-8(2)20-13-10(6-18)12(14(15,16)17)21-22(13)11-5-4-9(7-19-11)25(3,23)24/h4-5,7-8,20H,1-3H3